Home Halogens 1-(bromomethyl)cyclobutane-1-carbonitrile

1-(bromomethyl)cyclobutane-1-carbonitrile

CAS No.:
1909337-42-3
Catalog Number:
AG01C1J5
Molecular Formula:
C6H8BrN
Molecular Weight:
174.0384
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Product Description
Catalog Number:
AG01C1J5
Chemical Name:
1-(bromomethyl)cyclobutane-1-carbonitrile
CAS Number:
1909337-42-3
Molecular Formula:
C6H8BrN
Molecular Weight:
174.0384
MDL Number:
MFCD29047333
IUPAC Name:
1-(bromomethyl)cyclobutane-1-carbonitrile
InChI:
InChI=1S/C6H8BrN/c7-4-6(5-8)2-1-3-6/h1-4H2
InChI Key:
NMERHTBBQWPUKW-UHFFFAOYSA-N
SMILES:
BrCC1(CCC1)C#N
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.984g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.041g/mol
Monoisotopic Mass:
172.984g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties